[gmx-users] Fwd: Regarding trjorder

[Venkat Reddy]

Hello,

I have used the trjorder command to order water around 5 Angstrom radius of
a protein. Can anyone suggest how the obtained pdb file can be used to
analyse the system considering only this first shell of water around the
protein?

Please help me in this regard.

Thanks

-- 
With Best Wishes
Venkat Reddy Chirasani
PhD student
Laboratory of Computational Biophysics
Department of Biotechnology
IIT Madras
Chennai
INDIA-600036



-- 
With Best Wishes
Venkat Reddy Chirasani
PhD student
Laboratory of Computational Biophysics
Department of Biotechnology
IIT Madras
Chennai
INDIA-600036